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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50176851'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Adenosine receptor A1


(BOVINE)		BDBM50176851
PNG
(CHEMBL224098 | isopropyl 4-(benzylamino)-1-(2-chlo...)
Show SMILES CC(C)OC(=O)c1cnc2n(CC(Cl)c3ccccc3)ncc2c1NCc1ccccc1
Show InChI InChI=1S/C25H25ClN4O2/c1-17(2)32-25(31)21-14-28-24-20(23(21)27-13-18-9-5-3-6-10-18)15-29-30(24)16-22(26)19-11-7-4-8-12-19/h3-12,14-15,17,22H,13,16H2,1-2H3,(H,27,28)
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Similars
Article
PubMed
 559n/an/an/an/an/an/an/an/a



Università degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from adenosine A1 receptor in bovine cerebral cortical membranes

J Med Chem 48: 7172-85 (2005)


Article DOI: 10.1021/jm050407k
BindingDB Entry DOI: 10.7270/Q2N0163Q
More data for this
Ligand-Target Pair